dibutyl 2-[[N'-[(4S)-4-azanyl-5-butoxy-5-oxidanylidene-pentyl]carbamimidoyl]amino]butanedioate

Systemtic Name: dibutyl 2-[[N'-[(4S)-4-azanyl-5-butoxy-5-oxidanylidene-pentyl]carbamimidoyl]amino]butanedioate Openeye Name: dibutyl 2-[[N'-[(4S)-4-amino-5-butoxy-5-oxo-pentyl]carbamimidoyl]amino]butanedioate CAS Name: 2-[[amino-[(4S)-4-amino-5-butoxy-5-oxopentyl]iminomethyl]amino]butanedioic acid dibutyl ester IUPAC Name: dibutyl 2-[[N'-[(4S)-4-amino-5-butoxy-5-oxopentyl]carbamimidoyl]amino]butanedioate Traditional Name: 2-[[N'-[(4S)-4-amino-5-butoxy-5-keto-pentyl]amidino]amino]succinic acid dibutyl ester Formula: C22H42N4O6 MolecularWeight: 458.59208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(C(=O)OCCCC)NC(=NCCCC(C(=O)OCCCC)N)N

Isomeric SMILES

CCCCOC(=O)CC(C(=O)OCCCC)NC(=NCCC[C@@H](C(=O)OCCCC)N)N

InChI

InChI=1S/C22H42N4O6/c1-4-7-13-30-19(27)16-18(21(29)32-15-9-6-3)26-22(24)25-12-10-11-17(23)20(28)31-14-8-5-2/h17-18H,4-16,23H2,1-3H3,(H3,24,25,26)/t17-,18?/m0/s1