N-(3-azanylpropyl)-N-[4-[3-azanylpropyl-[3-[3,4-bis(oxidanyl)phenyl]propanoyl]amino]butyl]-3-[3,4-bis(oxidanyl)phenyl]propanamide

Systemtic Name: N-(3-azanylpropyl)-N-[4-[3-azanylpropyl-[3-[3,4-bis(oxidanyl)phenyl]propanoyl]amino]butyl]-3-[3,4-bis(oxidanyl)phenyl]propanamide Openeye Name: N-(3-aminopropyl)-N-[4-[3-aminopropyl-[3-(3,4-dihydroxyphenyl)propanoyl]amino]butyl]-3-(3,4-dihydroxyphenyl)propanamide CAS Name: N-(3-aminopropyl)-N-[4-[3-aminopropyl-[3-(3,4-dihydroxyphenyl)-1-oxopropyl]amino]butyl]-3-(3,4-dihydroxyphenyl)propanamide IUPAC Name: N-(3-aminopropyl)-N-[4-[3-aminopropyl-[3-(3,4-dihydroxyphenyl)propanoyl]amino]butyl]-3-(3,4-dihydroxyphenyl)propanamide Traditional Name: N-(3-aminopropyl)-N-[4-[3-aminopropyl-[3-(3,4-dihydroxyphenyl)propanoyl]amino]butyl]-3-(3,4-dihydroxyphenyl)propionamide Formula: C28H42N4O6 MolecularWeight: 530.65628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCC(=O)N(CCCCN(CCCN)C(=O)CCC2=CC(=C(C=C2)O)O)CCCN)O)O

Isomeric SMILES

C1=CC(=C(C=C1CCC(=O)N(CCCCN(CCCN)C(=O)CCC2=CC(=C(C=C2)O)O)CCCN)O)O

InChI

InChI=1S/C28H42N4O6/c29-13-3-17-31(27(37)11-7-21-5-9-23(33)25(35)19-21)15-1-2-16-32(18-4-14-30)28(38)12-8-22-6-10-24(34)26(36)20-22/h5-6,9-10,19-20,33-36H,1-4,7-8,11-18,29-30H2