ethyl (3S)-3-[4-[(4-carbamimidoylphenyl)amino]butanoylamino]pent-4-enoate

Systemtic Name: ethyl (3S)-3-[4-[(4-carbamimidoylphenyl)amino]butanoylamino]pent-4-enoate Openeye Name: ethyl (3S)-3-[4-(4-carbamimidoylanilino)butanoylamino]pent-4-enoate CAS Name: (3S)-3-[[4-(4-carbamimidoylanilino)-1-oxobutyl]amino]-4-pentenoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[4-(4-carbamimidoylanilino)butanoylamino]pent-4-enoate Traditional Name: (3S)-3-[4-(4-amidinoanilino)butanoylamino]pent-4-enoic acid ethyl ester Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C=C)NC(=O)CCCNC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CCOC(=O)C[C@@H](C=C)NC(=O)CCCNC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C18H26N4O3/c1-3-14(12-17(24)25-4-2)22-16(23)6-5-11-21-15-9-7-13(8-10-15)18(19)20/h3,7-10,14,21H,1,4-6,11-12H2,2H3,(H3,19,20)(H,22,23)/t14-/m1/s1