4-(3-azanylpropylamino)butyl 2-azanyl-2-[7-[bis(azanyl)methylideneamino]heptanoylamino]ethanoate

Systemtic Name: 4-(3-azanylpropylamino)butyl 2-azanyl-2-[7-[bis(azanyl)methylideneamino]heptanoylamino]ethanoate Openeye Name: 4-(3-aminopropylamino)butyl 2-amino-2-(7-guanidinoheptanoylamino)acetate CAS Name: 2-amino-2-[[7-(diaminomethylideneamino)-1-oxoheptyl]amino]acetic acid 4-(3-aminopropylamino)butyl ester IUPAC Name: 4-(3-aminopropylamino)butyl 2-amino-2-[7-(diaminomethylideneamino)heptanoylamino]acetate Traditional Name: 2-amino-2-(7-guanidinoheptanoylamino)acetic acid 4-(3-aminopropylamino)butyl ester Formula: C17H37N7O3 MolecularWeight: 387.52078

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCN=C(N)N)CCC(=O)NC(C(=O)OCCCCNCCCN)N

Isomeric SMILES

C(CCCN=C(N)N)CCC(=O)NC(C(=O)OCCCCNCCCN)N

InChI

InChI=1S/C17H37N7O3/c18-9-7-11-22-10-5-6-13-27-16(26)15(19)24-14(25)8-3-1-2-4-12-23-17(20)21/h15,22H,1-13,18-19H2,(H,24,25)(H4,20,21,23)