ethyl 4-[[N'-(naphthalen-1-ylmethyl)carbamimidoyl]carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[N'-(naphthalen-1-ylmethyl)carbamimidoyl]carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[N'-(1-naphthylmethyl)carbamimidoyl]carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[amino(1-naphthalenylmethylimino)methyl]amino]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[N'-(naphthalen-1-ylmethyl)carbamimidoyl]carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[[N'-(1-naphthylmethyl)amidino]carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)NC(=NCC2=CC=CC3=CC=CC=C32)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)NC(=NCC2=CC=CC3=CC=CC=C32)N

InChI

InChI=1S/C20H25N5O3/c1-2-28-20(27)25-12-10-24(11-13-25)19(26)23-18(21)22-14-16-8-5-7-15-6-3-4-9-17(15)16/h3-9H,2,10-14H2,1H3,(H3,21,22,23,26)