(2S)-N-(3-azanylpropyl)-2-[2-(3-azanylpropylamino)ethanoylamino]-3-phenyl-propanamide

Systemtic Name: (2S)-N-(3-azanylpropyl)-2-[2-(3-azanylpropylamino)ethanoylamino]-3-phenyl-propanamide Openeye Name: (2S)-N-(3-aminopropyl)-2-[[2-(3-aminopropylamino)acetyl]amino]-3-phenyl-propanamide CAS Name: (2S)-N-(3-aminopropyl)-2-[[2-(3-aminopropylamino)-1-oxoethyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-N-(3-aminopropyl)-2-[[2-(3-aminopropylamino)acetyl]amino]-3-phenylpropanamide Traditional Name: (2S)-N-(3-aminopropyl)-2-[[2-(3-aminopropylamino)acetyl]amino]-3-phenyl-propionamide Formula: C17H29N5O2 MolecularWeight: 335.44446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCN)NC(=O)CNCCCN

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCCN)NC(=O)CNCCCN

InChI

InChI=1S/C17H29N5O2/c18-8-4-10-20-13-16(23)22-15(17(24)21-11-5-9-19)12-14-6-2-1-3-7-14/h1-3,6-7,15,20H,4-5,8-13,18-19H2,(H,21,24)(H,22,23)/t15-/m0/s1